In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 20 | Yes |
Popular Name: (2R)-2-[[[(1R)-1-(4-methoxyphenyl)ethyl]-methyl-amino]methyl]pentanedinitrile (2R)-2-[[[(1R)-1-(4-methoxypheny…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.24 | 9.15 | -58.5 | 1 | 4 | 1 | 61 | 272.372 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 7.37 | -15.19 | 0 | 4 | 0 | 60 | 271.364 | 7 | ↓ |